(2-benzylcyclopropyl)methanamine

C11H15N — CID 56605942

IUPAC(2-benzylcyclopropyl)methanamine
SMILESNCC1CC1Cc1ccccc1
InChIInChI=1S/C11H15N/c12-8-11-7-10(11)6-9-4-2-1-3-5-9/h1-5,10-11H,6-8,12H2
InChIKeyJSQJWNFJQOUANU-UHFFFAOYSA-N
MW161.25 g/mol
LogP1.82
Rot. Bonds3

About (2-benzylcyclopropyl)methanamine

(2-benzylcyclopropyl)methanamine (PubChem CID 56605942) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is (2-benzylcyclopropyl)methanamine.

Molecular Properties

Compound Name(2-benzylcyclopropyl)methanamine
PubChem CID56605942
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name(2-benzylcyclopropyl)methanamine
SMILESNCC1CC1Cc1ccccc1
InChIInChI=1S/C11H15N/c12-8-11-7-10(11)6-9-4-2-1-3-5-9/h1-5,10-11H,6-8,12H2
InChIKeyJSQJWNFJQOUANU-UHFFFAOYSA-N
XLogP1.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2-benzylcyclopropyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S,4S)-2,5-dibenzylbicyclo[2.2.1]heptane
CID 101446934
N-[(2-benzylcyclopropyl)methyl]ethanamine
CID 62703862
(2-benzyloxolan-3-yl)methanamine
CID 79368410
(1S,2S,4S)-4-amino-2-benzylcyclopentan-1-ol
CID 166640244
N-[(2-benzylcyclopropyl)methyl]propan-1-amine
CID 62708370
N-[(2-benzylcyclopropyl)methyl]pyridin-3-amine
CID 173142630
(2-benzyloxan-3-yl)methanamine
CID 79367759
cis-(1R,2S)-2-benzylcyclopropane-1-carboxylic acid
CID 10487497
[(1S,2R)-2-methoxycyclopropyl]methylbenzene
CID 100914167
CID 162338619
CID 162338619
4-benzyloxolan-3-ol
CID 14785279
(1S,2R,5R)-2-benzylbicyclo[3.1.0]hexane
CID 158080473

Frequently Asked Questions

What is the IUPAC name of (2-benzylcyclopropyl)methanamine?
The IUPAC name of (2-benzylcyclopropyl)methanamine (CID 56605942) is (2-benzylcyclopropyl)methanamine.
What is the SMILES notation for (2-benzylcyclopropyl)methanamine?
The canonical SMILES for (2-benzylcyclopropyl)methanamine is NCC1CC1Cc1ccccc1.
What is the InChIKey of (2-benzylcyclopropyl)methanamine?
The InChIKey is JSQJWNFJQOUANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c12-8-11-7-10(11)6-9-4-2-1-3-5-9/h1-5,10-11H,6-8,12H2.
What are the key properties of (2-benzylcyclopropyl)methanamine?
(2-benzylcyclopropyl)methanamine has a molecular weight of 161.25 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzylcyclopropyl)methanamine is sourced from PubChem (CID 56605942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).